[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane

C30H48O4Si2 — CID 15120841

IUPAC[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
SMILESCCC(Cc1cccc(OC)c1)/C(O[Si](C)(C)C)=C(\O[Si](C)(C)C)C(CC)Cc1cccc(OC)c1
InChIInChI=1S/C30H48O4Si2/c1-11-25(19-23-15-13-17-27(21-23)31-3)29(33-35(5,6)7)30(34-36(8,9)10)26(12-2)20-24-16-14-18-28(22-24)32-4/h13-18,21-22,25-26H,11-12,19-20H2,1-10H3/b30-29+
InChIKeyMENBBKQTFPKBPW-QVIHXGFCSA-N
MW528.88 g/mol
LogP8.46
Rot. Bonds14

About [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane

[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane (PubChem CID 15120841) has the molecular formula C30H48O4Si2 and a molecular weight of 528.88 g/mol. Its IUPAC name is [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
PubChem CID15120841
Molecular FormulaC30H48O4Si2
Molecular Weight528.88 g/mol
Exact Mass528.31
IUPAC Name[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
SMILESCCC(Cc1cccc(OC)c1)/C(O[Si](C)(C)C)=C(\O[Si](C)(C)C)C(CC)Cc1cccc(OC)c1
InChIInChI=1S/C30H48O4Si2/c1-11-25(19-23-15-13-17-27(21-23)31-3)29(33-35(5,6)7)30(34-36(8,9)10)26(12-2)20-24-16-14-18-28(22-24)32-4/h13-18,21-22,25-26H,11-12,19-20H2,1-10H3/b30-29+
InChIKeyMENBBKQTFPKBPW-QVIHXGFCSA-N
XLogP8.46
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500528.88
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(5-ethylthiophen-2-yl)methyl]-3-(3-methoxyphenyl)propanoic acid
CID 60793231
2-[(3-bromophenyl)methyl]-3-(3-methoxyphenyl)propanoic acid
CID 60793228
1-(3-methoxyphenyl)-N-methylbutan-2-amine
CID 61065553
1-(3-methoxyphenyl)pentan-2-ol
CID 61261615
[1,8-bis(3-methoxyphenyl)-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
CID 68525614
[(E)-1,8-bis(3-methoxyphenyl)-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
CID 68525612
1-(3-methoxyphenyl)-3-methylpentane-2,3-diol
CID 103448604
2-(furan-2-ylmethyl)-3-(3-methoxyphenyl)propanoic acid
CID 63000304
2-[(3-methoxyphenyl)methyl]-4-methylpent-4-enoic acid
CID 79419135
4-hydroxy-2-[(3-methoxyphenyl)methyl]-4-methylpentanoic acid
CID 79418575
1-[(2S)-2-bromopropyl]-3-methoxybenzene
CID 129368805
1-methoxy-3-(2-methoxypropyl)benzene
CID 56987806

Frequently Asked Questions

What is the IUPAC name of [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane?
The IUPAC name of [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane (CID 15120841) is [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane.
What is the SMILES notation for [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane?
The canonical SMILES for [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane is CCC(Cc1cccc(OC)c1)/C(O[Si](C)(C)C)=C(\O[Si](C)(C)C)C(CC)Cc1cccc(OC)c1.
What is the InChIKey of [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane?
The InChIKey is MENBBKQTFPKBPW-QVIHXGFCSA-N. The full InChI is InChI=1S/C30H48O4Si2/c1-11-25(19-23-15-13-17-27(21-23)31-3)29(33-35(5,6)7)30(34-36(8,9)10)26(12-2)20-24-16-14-18-28(22-24)32-4/h13-18,21-22,25-26H,11-12,19-20H2,1-10H3/b30-29+.
What are the key properties of [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane?
[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane has a molecular weight of 528.88 g/mol, XLogP of 8.46, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane is sourced from PubChem (CID 15120841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).